9KCY

Crystal structure of Sorghum bicolor SPS complexed with YH24773

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-10-31
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.979183
Spacegroup name	C 1 2 1
Unit cell lengths	136.480, 55.861, 94.407
Unit cell angles	90.00, 108.46, 90.00

Refinement procedure

Resolution	44.774 - 2.429
R-factor	0.2111
Rwork	0.208
R-free	0.26520
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.508
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.16_3549: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.774	2.516
High resolution limit [Å]	2.429	2.429
Number of reflections	25419	2426
<I/σ(I)>	8.32
Completeness [%]	98.6
Redundancy	10.478
CC(1/2)	0.994	0.801

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	KSCN, Bis-Tris Propane, PEG3350